Name: Name:1-[1-methyl-5-(trifluoromethyl)-1H-pyrrol-2-yl]ethan-1-one
Brand: Angene
SKU: AG01B8HV
Rating: 90 (10 reviews)

1-[1-methyl-5-(trifluoromethyl)-1H-pyrrol-2-yl]ethan-1-one

CAS No.:

1068468-94-9

Catalog Number:

AG01B8HV

Molecular Formula:

C8H8F3NO

Molecular Weight:

191.1504

Catalog Number:

AG01B8HV

Chemical Name:

1-[1-methyl-5-(trifluoromethyl)-1H-pyrrol-2-yl]ethan-1-one

CAS Number:

1068468-94-9

Molecular Formula:

C8H8F3NO

Molecular Weight:

191.1504

MDL Number:

MFCD21336799

IUPAC Name:

1-[1-methyl-5-(trifluoromethyl)pyrrol-2-yl]ethanone

InChI:

InChI=1S/C8H8F3NO/c1-5(13)6-3-4-7(12(6)2)8(9,10)11/h3-4H,1-2H3

InChI Key:

KKAKTPJEFPRAFX-UHFFFAOYSA-N

SMILES:

CC(=O)c1ccc(n1C)C(F)(F)F

Complexity:

214

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

191.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

191.153g/mol

Monoisotopic Mass:

191.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

22A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6